ethyl 4-[2-[[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[[5-methyl-2-(o-tolyl)oxazol-4-yl]methylsulfanyl]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[[5-methyl-2-(2-methylphenyl)-4-oxazolyl]methylthio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[5-methyl-2-(o-tolyl)oxazol-4-yl]methylthio]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CSCC2=C(OC(=N2)C3=CC=CC=C3C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CSCC2=C(OC(=N2)C3=CC=CC=C3C)C

InChI

InChI=1S/C21H27N3O4S/c1-4-27-21(26)24-11-9-23(10-12-24)19(25)14-29-13-18-16(3)28-20(22-18)17-8-6-5-7-15(17)2/h5-8H,4,9-14H2,1-3H3